List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
165742 |
74590240 |
1 |
O2N4C23H35 |
A2B4C23D35 |
-55.18 |
4.11 |
0.0 |
0.0 |
1 |
|
|
165743 |
74590241 |
1 |
OF3N3C18H21 |
AB3C3D18E21 |
-119.94 |
7.58 |
0.0 |
0.0 |
1 |
|
|
165744 |
74590749 |
1 |
ON3C20H32 |
AB3C20D32 |
-14.19 |
4.55 |
0.0 |
0.0 |
0 |
|
|
165745 |
74591064 |
1 |
NO4C20H21 |
AB4C20D21 |
-104.74 |
4.72 |
-8.55 |
-0.51 |
0 |
|
|
165746 |
74591065 |
1 |
FNO4H18C19 |
ABC4D18E19 |
-140.01 |
2.4 |
-8.73 |
-0.73 |
1 |
|
|
165747 |
74591066 |
1 |
NOBr2C20H26 |
ABC2D20E26 |
2.94 |
9.76 |
0.0 |
0.0 |
0 |
|
|
165748 |
74591067 |
1 |
BrOS2N3H12C15 |
ABC2D3E12F15 |
63.26 |
2.22 |
-8.86 |
-1.61 |
0 |
|
|
165749 |
74591413 |
1 |
SO3N4C21H32 |
AB3C4D21E32 |
-134.96 |
5.18 |
-8.63 |
-0.13 |
0 |
|
|
165750 |
74591555 |
1 |
N4O5C25H38 |
A4B5C25D38 |
-200.14 |
4.87 |
-8.44 |
-0.69 |
0 |
|
|
165751 |
74592298 |
1 |
ON4C30H38 |
AB4C30D38 |
6.25 |
1.51 |
-8.75 |
-0.46 |
0 |
|
|
165752 |
74592498 |
1 |
SO2N6C16H16 |
AB2C6D16E16 |
44.88 |
7.2 |
-9.11 |
-0.54 |
0 |
|
|
165753 |
74592980 |
1 |
N5O5C18H25 |
A5B5C18D25 |
-131.0 |
1.81 |
-10.05 |
-1.54 |
0 |
|
|
165754 |
74593003 |
1 |
N5O5C18H25 |
A5B5C18D25 |
-127.75 |
5.51 |
-9.72 |
-1.06 |
0 |
|
|
165755 |
74593004 |
2 |
N2O2C10H15 |
A2B2C10D15 |
-171.23 |
6.77 |
-8.66 |
0.1 |
0 |
|
|
165756 |
74593595 |
1 |
SO4N5C21H27 |
AB4C5D21E27 |
-143.96 |
3.51 |
-9.04 |
-0.81 |
1 |
|
|
165757 |
74593637 |
1 |
OSN2C18H29 |
ABC2D18E29 |
-12.55 |
5.3 |
0.0 |
0.0 |
0 |
|
|
165758 |
74593723 |
1 |
O2N4C17H18 |
A2B4C17D18 |
17.77 |
6.98 |
-9.2 |
-0.76 |
0 |
|
|
165759 |
74593724 |
2 |
NOH10C11 |
ABC10D11 |
13.0 |
2.15 |
-9.08 |
-0.58 |
0 |
|
|
165760 |
74593725 |
2 |
O3C10H10 |
A3B10C10 |
-190.37 |
5.77 |
-8.86 |
-0.64 |
0 |
|
|
165761 |
74593908 |
1 |
OSN4H18C22 |
ABC4D18E22 |
86.51 |
5.66 |
-8.55 |
-1.09 |
0 |
|
|
165762 |
74594074 |
1 |
ON2F3H13C16 |
AB2C3D13E16 |
-134.41 |
1.22 |
-10.02 |
-1.18 |
0 |
|
|
165763 |
74594290 |
1 |
ClN2O4H21C23 |
AB2C4D21E23 |
-85.22 |
2.73 |
-8.99 |
-0.72 |
-1 |
|
|
165764 |
74594528 |
1 |
NO2C11H12 |
AB2C11D12 |
-38.14 |
1.41 |
0.0 |
0.0 |
0 |
|
|
165765 |
74594926 |
1 |
SN4O4C18H24 |
AB4C4D18E24 |
-133.24 |
6.17 |
-8.98 |
-1.26 |
0 |
|
|
165766 |
74594945 |
1 |
SO4N5C23H35 |
AB4C5D23E35 |
-166.35 |
9.16 |
-9.08 |
-0.58 |
0 |
|
|
165767 |
74595244 |
1 |
SO3N4C14H18 |
AB3C4D14E18 |
-39.66 |
1.69 |
-8.6 |
-0.68 |
0 |
|
|
165768 |
74595245 |
1 |
FSO3N4C17H17 |
ABC3D4E17F17 |
-70.65 |
1.96 |
-9.09 |
-1.07 |
0 |
|
|
165769 |
74595423 |
1 |
N2O7C24H28 |
A2B7C24D28 |
-217.75 |
7.81 |
-7.87 |
-0.95 |
1 |
|
|
165770 |
74595778 |
1 |
S2O3N4C19H23 |
A2B3C4D19E23 |
-67.92 |
4.21 |
0.0 |
0.0 |
0 |
|
|
165771 |
74596084 |
1 |
S2N3O3C17H21 |
A2B3C3D17E21 |
-84.47 |
6.55 |
-9.24 |
-0.55 |
0 |
|
|
165772 |
74596732 |
1 |
S2O3N5C21H29 |
A2B3C5D21E29 |
-85.67 |
7.74 |
-9.36 |
-1.39 |
0 |
|
|
165773 |
74596774 |
1 |
ClFO3N4C19H26 |
ABC3D4E19F26 |
-184.02 |
5.71 |
-9.75 |
-0.9 |
0 |
|
|
165774 |
74596791 |
1 |
SN2O3C18H20 |
AB2C3D18E20 |
-98.55 |
3.94 |
-9.36 |
-0.97 |
0 |
|
|
165775 |
74597260 |
1 |
SO3N4C23H24 |
AB3C4D23E24 |
-73.01 |
5.31 |
-8.89 |
-0.65 |
0 |
|
|
165776 |
74597277 |
1 |
SN2O5C16H22 |
AB2C5D16E22 |
-192.52 |
4.5 |
-8.71 |
-0.08 |
1 |
|
|
165777 |
74597309 |
1 |
O3N4C23H35 |
A3B4C23D35 |
-106.25 |
4.05 |
0.0 |
0.0 |
1 |
|
|
165778 |
74597310 |
1 |
N2O2F3C19H22 |
A2B2C3D19E22 |
-180.19 |
3.18 |
0.0 |
0.0 |
1 |
|
|
165779 |
74597311 |
1 |
OSCl2N2C16H19 |
ABC2D2E16F19 |
8.89 |
5.96 |
0.0 |
0.0 |
0 |
|
|
165780 |
74597610 |
1 |
OSN3C19H23 |
ABC3D19E23 |
17.64 |
4.73 |
-9.01 |
-0.49 |
0 |
|
|
165781 |
74598333 |
1 |
ClN2O4C23H25 |
AB2C4D23E25 |
-135.76 |
1.8 |
-9.32 |
-0.75 |
0 |
|
|
165782 |
74598334 |
1 |
SO3N7C22H31 |
AB3C7D22E31 |
-63.27 |
6.08 |
-8.57 |
-0.7 |
0 |
|
|
165783 |
74598375 |
1 |
NO4C21H25 |
AB4C21D25 |
-111.09 |
7.37 |
-8.59 |
-0.25 |
0 |
|
|
165784 |
74598376 |
1 |
NO3C21H25 |
AB3C21D25 |
-76.27 |
4.12 |
-8.46 |
-0.11 |
0 |
|
|
165785 |
74598377 |
1 |
NO3C14H19 |
AB3C14D19 |
-96.75 |
6.55 |
-8.91 |
-0.27 |
1 |
|
|
165786 |
74598389 |
1 |
N3O3C14H18 |
A3B3C14D18 |
-94.53 |
5.34 |
0.0 |
0.0 |
0 |
|
|
165787 |
74598450 |
1 |
SF2N5O5H17C21 |
AB2C5D5E17F21 |
-163.04 |
8.39 |
-9.33 |
-1.85 |
0 |
|
|
165788 |
74598451 |
1 |
S2N3O3C18H27 |
A2B3C3D18E27 |
-102.32 |
7.82 |
-9.1 |
-1.59 |
0 |
|
|
165789 |
74598483 |
1 |
N4O4H22C23 |
A4B4C22D23 |
-74.78 |
3.09 |
-8.38 |
-0.86 |
0 |
|
|
165790 |
74598804 |
1 |
O3N5C25H31 |
A3B5C25D31 |
-64.01 |
3.52 |
-8.68 |
-0.01 |
0 |
|
|
165791 |
74599185 |
1 |
SO2N3C26H35 |
AB2C3D26E35 |
-93.22 |
4.94 |
-8.48 |
0.18 |
1 |